Structure Information
Structure

Compound Identification

SMILES

CON=C(C1=CC=CC=C1)C1=CC2=C(C=C1)N(CCOC1=CC=C(CC(C(O)=O)C(=O)OC)C=C1)C(=O)S2

InChIKey

InChIKey=FIIPRWSELXWVFB-UHFFFAOYSA-N

Formula

C28H26N2O7S

Mass

534.58

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Phenylpropanoic acids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpropanoic acids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

3-phenylpropanoic-acid - 1,3-benzothiazole - Phenoxy compound - Phenol ether - Alkyl aryl ether - Fatty acid ester - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - 1,3-dicarbonyl compound - Benzenoid - Fatty acyl - Azole - Thiazole - Heteroaromatic compound - Methyl ester - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Carboxylic acid - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpropanoic acids. These are compounds with a structure containing a benzene ring conjugated to a propanoic acid.

External Descriptors

Not available

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